Extensible Simulation Package for Research on Soft Matter

About

Coarse-grained models ESPResSo is a highly versatile software package for performing and analyzing scientific Molecular Dynamics many-particle simulations of “coarse-grained” bead-spring models as they are used in soft matter research in physics, chemistry and molecular biology. It can be used to simulate systems such as polymers, liquid crystals, colloids, ferrofluids and biological systems, for example …

ESPResSo can perform simulations of various physical systems in different ensembles. It is optimized for coarse-grained models and has the following characteristics: ESPResSo is alive! It is actively maintained and refined by members of the Institute for Computational Physics, Stuttgart and contributors from all around the globe. ESPResSo is controlled by python scripts, which gives it its great flexibility …

The following tools and libraries, including header files, are required to be able to compile and use ESPResSo 4.0. Read the Installation instructions for the requirements. CMake The build system is based on CMake. C++ Compiler C++11 capable C++ compiler (e.g., Gcc 4.8.1 or later). Boost A number of advanced C++ features used by ESPResSo is …